N-(2-chloranyl-6-methyl-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-1,3-benzothiazole-6-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-2-[[[(1-ethyl-2-pyrrolidinyl)methylamino]-oxomethyl]amino]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-2-[(1-ethylpyrrolidin-2-yl)methylcarbamoylamino]-1,3-benzothiazole-6-carboxamide Formula: C23H26ClN5O2S MolecularWeight: 472.00284

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

Isomeric SMILES

CCN1CCCC1CNC(=O)NC2=NC3=C(S2)C=C(C=C3)C(=O)NC4=C(C=CC=C4Cl)C

InChI

InChI=1S/C23H26ClN5O2S/c1-3-29-11-5-7-16(29)13-25-22(31)28-23-26-18-10-9-15(12-19(18)32-23)21(30)27-20-14(2)6-4-8-17(20)24/h4,6,8-10,12,16H,3,5,7,11,13H2,1-2H3,(H,27,30)(H2,25,26,28,31)